Chemical Properties of Naphthalene, 1-(phenylthio)-

InChI

InChI=1S/C16H12S/c1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16/h1-12H

InChI Key

UUZCTKYYDFEULY-UHFFFAOYSA-N

Formula

C16H12S

SMILES

c1ccc(Sc2cccc3ccccc23)cc1

Molecular Weight¹

236.34

Other Names

• Sulfide, 1-naphthyl phenyl
• 1-(Phenylthio)naphthalene
• 1-(Phenylsulfanyl)naphthalene
• 1-Phenylnaphthylsulfide

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Pressure, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[464.17; 538.90]	J/mol×K	[711.78; 991.92]
Cp,gas	464.17	J/mol×K	711.78	Joback Calculated Property
Cp,gas	479.91	J/mol×K	758.47	Joback Calculated Property
Cp,gas	494.12	J/mol×K	805.16	Joback Calculated Property
Cp,gas	506.97	J/mol×K	851.85	Joback Calculated Property
Cp,gas	518.61	J/mol×K	898.54	Joback Calculated Property
Cp,gas	529.20	J/mol×K	945.23	Joback Calculated Property
Cp,gas	538.90	J/mol×K	991.92	Joback Calculated Property

Similar Compounds

Find more compounds similar to Naphthalene, 1-(phenylthio)-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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